Compound Identification
SMILES
CC1=CC=C(NC(=O)NNC(=O)CC2=CCN(CC2)C2=CC=C(C=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=OSIFTMDEDOQZAX-UHFFFAOYSA-N
Formula
C21H23N5O4
Mass
409.446
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylureas
Alternative Parents
Nitrobenzenes Aniline and substituted anilines Dialkylarylamines Nitroaromatic compounds Toluenes Hydropyridines Semicarbazides Amino acids and derivatives Carboxylic acid hydrazides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Organic zwitterions Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-phenylurea - Nitrobenzene - Nitroaromatic compound - Dialkylarylamine - Aniline or substituted anilines - Toluene - Hydropyridine - Semicarbazide - Amino acid or derivatives - Carboxylic acid hydrazide - Organic nitro compound - Tertiary amine - C-nitro compound - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic oxoazanium - Organic oxide - Organonitrogen compound - Amine - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organic salt - Carbonyl group - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
External Descriptors
Not available